5-fluoranyl-4-iodanyl-2-[(2-methylpropan-2-yl)oxycarbonyloxy]indole-1-carboxylic acid

Systemtic Name: 5-fluoranyl-4-iodanyl-2-[(2-methylpropan-2-yl)oxycarbonyloxy]indole-1-carboxylic acid Openeye Name: 2-tert-butoxycarbonyloxy-5-fluoro-4-iodo-indole-1-carboxylic acid CAS Name: 5-fluoro-4-iodo-2-[(2-methylpropan-2-yl)oxy-oxomethoxy]-1-indolecarboxylic acid IUPAC Name: 5-fluoro-4-iodo-2-[(2-methylpropan-2-yl)oxycarbonyloxy]indole-1-carboxylic acid Traditional Name: 2-tert-butoxycarbonyloxy-5-fluoro-4-iodo-indole-1-carboxylic acid Formula: C14H13FINO5 MolecularWeight: 421.159593

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)OC1=CC2=C(N1C(=O)O)C=CC(=C2I)F

Isomeric SMILES

CC(C)(C)OC(=O)OC1=CC2=C(N1C(=O)O)C=CC(=C2I)F

InChI

InChI=1S/C14H13FINO5/c1-14(2,3)22-13(20)21-10-6-7-9(17(10)12(18)19)5-4-8(15)11(7)16/h4-6H,1-3H3,(H,18,19)